N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine

C19H22N2 — CID 43103805

IUPACN-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine
SMILESCCCc1ccc(C(C)Nc2ccc3[nH]ccc3c2)cc1
InChIInChI=1S/C19H22N2/c1-3-4-15-5-7-16(8-6-15)14(2)21-18-9-10-19-17(13-18)11-12-20-19/h5-14,20-21H,3-4H2,1-2H3
InChIKeyUORGVXNWRUBEAM-UHFFFAOYSA-N
MW278.40 g/mol
LogP5.29
Rot. Bonds5

About N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine

N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine (PubChem CID 43103805) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine.

Molecular Properties

Compound NameN-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine
PubChem CID43103805
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC NameN-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine
SMILESCCCc1ccc(C(C)Nc2ccc3[nH]ccc3c2)cc1
InChIInChI=1S/C19H22N2/c1-3-4-15-5-7-16(8-6-15)14(2)21-18-9-10-19-17(13-18)11-12-20-19/h5-14,20-21H,3-4H2,1-2H3
InChIKeyUORGVXNWRUBEAM-UHFFFAOYSA-N
XLogP5.29
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.40
LogP ≤ 55.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-fluorophenyl)ethyl]-1H-indol-5-amine
CID 43204264
4-fluoro-N-[1-(4-propylphenyl)ethyl]aniline
CID 43094286
N-[1-(3-methylphenyl)ethyl]-1H-indol-5-amine
CID 43768662
N-(1-thiophen-3-ylethyl)-1H-indol-5-amine
CID 62089795
4-methyl-N-[1-(4-propylphenyl)ethyl]aniline
CID 43111793
N-[1-(3-chlorophenyl)ethyl]-1H-indol-5-amine
CID 43093889
N-octan-2-yl-1H-indol-5-amine
CID 43130007
4-chloro-N-[1-(4-propylphenyl)ethyl]aniline
CID 43098857
N-(1-phenylethyl)-4-propylaniline
CID 43078217
3-ethynyl-N-[1-(4-propylphenyl)ethyl]aniline
CID 43101198
4-chloro-3-methoxy-N-[1-(4-propylphenyl)ethyl]aniline
CID 107621050
2-methoxy-5-[1-(4-propylphenyl)ethylamino]phenol
CID 43743777

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine?
The IUPAC name of N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine (CID 43103805) is N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine.
What is the SMILES notation for N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine?
The canonical SMILES for N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine is CCCc1ccc(C(C)Nc2ccc3[nH]ccc3c2)cc1.
What is the InChIKey of N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine?
The InChIKey is UORGVXNWRUBEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-3-4-15-5-7-16(8-6-15)14(2)21-18-9-10-19-17(13-18)11-12-20-19/h5-14,20-21H,3-4H2,1-2H3.
What are the key properties of N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine?
N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine has a molecular weight of 278.40 g/mol, XLogP of 5.29, 5 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-propylphenyl)ethyl]-1H-indol-5-amine is sourced from PubChem (CID 43103805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).